2-tert-butyl-4-[[2-[(3-chlorophenyl)methyl]-4-fluoranyl-phenyl]amino]piperidine-1-carboxylate

Systemtic Name: 2-tert-butyl-4-[[2-[(3-chlorophenyl)methyl]-4-fluoranyl-phenyl]amino]piperidine-1-carboxylate Openeye Name: 2-tert-butyl-4-[2-[(3-chlorophenyl)methyl]-4-fluoro-anilino]piperidine-1-carboxylate CAS Name: 2-tert-butyl-4-[2-[(3-chlorophenyl)methyl]-4-fluoroanilino]-1-piperidinecarboxylate IUPAC Name: 2-tert-butyl-4-[2-[(3-chlorophenyl)methyl]-4-fluoroanilino]piperidine-1-carboxylate Traditional Name: 2-tert-butyl-4-[2-(3-chlorobenzyl)-4-fluoro-anilino]piperidine-1-carboxylate Formula: C23H27ClFN2O2- MolecularWeight: 417.924083

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CC(CCN1C(=O)[O-])NC2=C(C=C(C=C2)F)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C)(C)C1CC(CCN1C(=O)[O-])NC2=C(C=C(C=C2)F)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C23H28ClFN2O2/c1-23(2,3)21-14-19(9-10-27(21)22(28)29)26-20-8-7-18(25)13-16(20)11-15-5-4-6-17(24)12-15/h4-8,12-13,19,21,26H,9-11,14H2,1-3H3,(H,28,29)/p-1